Information card for entry 2008204

Structure parameters

• Chemical name: dioxo-di-μ-dioxo-bis(difluoroacetato)-bis-(2,2 -bipyridine)-dimolybdenum(V)
• Formula: C24 H22 F4 Mo2 N4 O10
• Calculated formula: C24 H22 F4 Mo2 N4 O10
• SMILES: FC(F)C(=O)O[Mo]123([n]4ccccc4c4cccc[n]14)(O[Mo]13([n]3ccccc3c3cccc[n]13)(O2)(=O)OC(=O)C(F)F)=O.O.O
• Title of publication: Di-μ-oxo-bis[(2,2'-bipyridine)(difluoroacetato)oxomolybdenum(V)] dihydrate
• Authors of publication: Webb, Thomas R.; Talbott, E. Shane
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1999
• Journal volume: 55
• Journal issue: 3
• Pages of publication: 370 - 372
• a: 16.734 ± 0.003 Å
• b: 10.267 ± 0.002 Å
• c: 17.173 ± 0.004 Å
• α: 90°
• β: 110.34 ± 0.02°
• γ: 90°
• Cell volume: 2766.5 ± 1 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.03
• Residual factor for significantly intense reflections: 0.024
• Weighted residual factors for all reflections: 0.06
• Weighted residual factors for significantly intense reflections: 0.056
• Goodness-of-fit parameter for all reflections: 1.12
• Goodness-of-fit parameter for significantly intense reflections: 1.129
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No